SCHEMBL6241985

SCHEMBL6241985

Nc1nc2c(ncn2[C@@H]2O[C@H](COCCCCn3ccnc3)[C@@H](O)[C@H]2O)c(=O)[nH]1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HINT1 P49773 6/20 0.58
NT5E P21589 1/20 0.58
GSK3A P49840 2/20 0.57
RPS6KA3 P51812 2/20 0.57
MAPK14 Q16539 2/20 0.57
TGM2 P21980 1/20 0.54
PNP P00491 1/20 0.53
KRAS P01116 9/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6245258 0.86 HINT1 (0.69) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL1424945 0.85 HINT1 (0.68) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL6241925 0.85 HINT1 (0.68) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL1425533 0.85 HINT1 (0.68) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL5347476 0.85 HINT1 (0.68) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL5962965 0.85 HPGD (0.49) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL1738169 0.85 HPGD (0.49) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL6889003 0.85 HINT1 (0.70) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL2533738 0.84 HINT1 (0.69) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL6826563 0.84 HINT1 (0.68) HINT1NT5EGSK3ARPS6KA3MAPK14

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1223173-B1 Novel 2'-O-alkyl nucleosides and phosphoramidites processes for the preparation and uses thereof ISIS PHARMACEUTICALS INC (US) 2005-07-13 EP disclosed
EP-0651759-A4 NOVEL 2'-O-ALKYL NUCLEOSIDES AND PHOSPHORAMIDITES PROCESSES FOR THE PREPARATION AND USES THEREOF. ISIS PHARMACEUTICALS INC (US) 1995-10-25 EP disclosed
EP-0651759-A1 NOVEL 2'-O-ALKYL NUCLEOSIDES AND PHOSPHORAMIDITES PROCESSES FOR THE PREPARATION AND USES THEREOF ISIS PHARMACEUTICALS, INC. (US) 1995-05-10 EP disclosed
WO-1994002501-A1 NOVEL 2'-O-ALKYL NUCLEOSIDES AND PHOSPHORAMIDITES PROCESSES FOR THE PREPARATION AND USES THEREOF ISIS PHARMACEUTICALS, INC. (US) 1994-02-03 WO disclosed